Geometry & MOs

Info

ID:	258326
PubChem CID:	103152912
Reduced:	N2O4C13H16 (1)
Stoich.:	A2B4C13D16 (1)
Weight, g/mol:	282.121572
ΔH_f, kcal/mol:	-128.23
Dipole, Da:	5.15
IP(EA), eV:	-9.85(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[3-(2-oxopyridin-1-yl)propanoylamino]butanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)/C=C/C1=CN=CC=C1

DOS

IR

Vibrations